RDKit 3D 47 49 0 0 0 0 0 0 0 0999 V2000 2.1659 -0.7900 -1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6363 0.3234 -1.2119 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1715 0.5014 -0.8102 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2249 -0.3220 0.4353 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2960 -1.7025 0.0519 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3183 -2.5709 1.1865 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9561 -2.5705 1.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9884 -3.4452 2.9676 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3463 -3.3057 3.6694 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3723 -3.9841 4.9202 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7406 -4.8982 2.5283 C 0 0 1 0 0 0 0 0 0 0 0 0 0.7369 -5.7874 3.6506 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5994 -4.9878 1.7972 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7691 -6.3231 1.2974 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6509 -3.9779 0.6538 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9559 -4.0247 0.0566 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4983 0.0658 0.9767 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7071 1.4088 1.0884 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9941 2.3524 0.4696 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0863 2.0094 -0.4974 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1867 2.7731 -1.6864 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5021 2.3752 0.0078 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7609 3.7809 -0.1006 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4116 1.5832 -0.9419 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5294 2.2855 -2.1805 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2155 -0.8376 -2.0151 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5625 -1.6734 -1.9253 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4742 0.2489 -1.6617 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5333 -0.1979 1.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1001 -2.2399 1.8827 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2128 -3.1410 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -3.6936 3.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5696 -2.2492 3.8526 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9483 -4.8586 4.7806 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -5.2337 1.8565 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3724 -6.6295 3.3033 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4292 -4.8258 2.4963 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5421 -6.2744 0.6979 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0587 -4.2676 -0.1314 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9891 -3.2657 -0.5601 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5556 1.6228 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2359 3.4005 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4772 2.5009 -2.3565 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6587 2.0595 1.0464 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0728 4.1283 -0.7068 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4085 1.4135 -0.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9188 3.1493 -1.9386 H 0 0 0 0 0 0 0 0 0 0 0 0 24 25 1 0 20 19 1 0 2 1 2 3 3 4 1 0 4 5 1 0 4 17 1 0 17 18 1 0 20 22 1 0 22 24 1 0 24 2 1 0 2 3 1 0 18 19 2 0 20 21 1 6 3 20 1 0 22 23 1 0 6 15 1 0 15 13 1 0 13 11 1 0 11 8 1 0 8 7 1 0 7 6 1 0 11 12 1 0 13 14 1 0 15 16 1 0 9 10 1 0 8 9 1 0 6 5 1 0 4 29 1 1 18 41 1 0 19 42 1 0 3 28 1 6 22 44 1 1 24 46 1 1 21 43 1 0 23 45 1 0 25 47 1 0 1 26 1 0 1 27 1 0 6 30 1 1 11 35 1 6 12 36 1 0 13 37 1 1 14 38 1 0 15 39 1 6 16 40 1 0 9 32 1 0 9 33 1 0 8 31 1 1 10 34 1 0 M END